A deep potential molecular dynamics study on the ionic structure and transport properties of NaCl-CaCl2 molten salt
Gegentana, Liu Cui, Leping Zhou, Xiaoze Du
Topics & Concepts
Molecular dynamicsDiffusionIonic liquidMolten saltIonic bondingIonViscosityWork (physics)Thermal diffusivityThermodynamicsChemistryAtom (system on chip)Chemical physicsThermal stabilityMaterials scienceInorganic chemistryComputational chemistryOrganic chemistryPhysicsComputer scienceCatalysisEmbedded systemPhase Change Materials ResearchMolten salt chemistry and electrochemical processesThermal Expansion and Ionic Conductivity